Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 6/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | WDR5 | P61964 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6505593 | 0.90 | ADORA2A (0.35) | ADORA1ADORA2AALDH1A1KDM4EHPGD | |
| Trifluoroacetic Acid SCHEMBL6499170 | 0.90 | ADORA2A (0.39) | ADORA1ADORA2AALDH1A1MAPTNPSR1 | |
| SCHEMBL6531507 | 0.89 | PARP1 (0.36) | ADORA2AALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL6494741 | 0.87 | PPARA (0.39) | ADORA1ADORA2AMAPTHDAC1WDR5 | |
| SCHEMBL6505045 | 0.86 | SMN1; SMN2 (0.35) | ADORA1ADORA2AALDH1A1KDM4EHPGD | |
| SCHEMBL6495822 | 0.85 | SHMT1 (0.39) | MAPTKDM4EHPGDWDR5KMT2A | |
| SCHEMBL6503597 | 0.85 | KDM4E (0.36) | ALDH1A1MAPTNPSR1KDM4EHDAC1 | |
| SCHEMBL6504395 | 0.85 | PPARA (0.37) | MAPTWDR5SMN1; SMN2GAA | |
| SCHEMBL6498709 | 0.82 | CDK2 (0.34) | MAPTWDR5NPC1 | |
| Trifluoroacetic Acid SCHEMBL6505587 | 0.80 | PPARA (0.38) | ADORA1ADORA2AALDH1A1MAPTHPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6884821-B1 | Carboxylic acid derivatives and drugs containing the same | EISAI CO., LTD. (JP) | 2005-04-26 | — | — | US | disclosed |
| EP-1216980-A1 | CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME | Eisai Co., Ltd. (JP) | 2002-06-26 | — | — | EP | disclosed |